Crystal structure of ethyl 2-{4-[(2-oxo-3-phenyl-1,2-di­hydro­quinoxalin-1-yl)meth­yl]-1H-1,2,3-triazol-1-yl}acetate

The quinoxaline portion of the title mol­ecule, C(21)H(19)N(5)O(3), is not quite planar as indicated by a dihedral angle of 3.38 (7)° between the constituent rings. The mol­ecule is ‘U-shaped’, which is consolidated by an intra­molecular anti­parallel carbonyl electrostatic inter­action with C··O di...

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Autores principales: Abad, Nadeem, Missioui, Mohcine, Alsubari, Abdulsalam, Mague, Joel T., Essassi, El Mokhtar, Ramli, Youssef
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2022
Materias:
Data Reports
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9635411/
https://www.ncbi.nlm.nih.gov/pubmed/36341047
http://dx.doi.org/10.1107/S2414314622006939
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author Abad, Nadeem
Missioui, Mohcine
Alsubari, Abdulsalam
Mague, Joel T.
Essassi, El Mokhtar
Ramli, Youssef
author_facet Abad, Nadeem
Missioui, Mohcine
Alsubari, Abdulsalam
Mague, Joel T.
Essassi, El Mokhtar
Ramli, Youssef
author_sort Abad, Nadeem
collection PubMed
description The quinoxaline portion of the title mol­ecule, C(21)H(19)N(5)O(3), is not quite planar as indicated by a dihedral angle of 3.38 (7)° between the constituent rings. The mol­ecule is ‘U-shaped’, which is consolidated by an intra­molecular anti­parallel carbonyl electrostatic inter­action with C··O distances of 2.8905 (16) and 3.0221 (15) Å, in the crystal forms corrugated layers through C—H⋯O and C—H⋯N hydrogen bonds and C—H⋯π(ring) and π-stacking inter­actions. [Image: see text]
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spelling pubmed-96354112022-11-04 Crystal structure of ethyl 2-{4-[(2-oxo-3-phenyl-1,2-di­hydro­quinoxalin-1-yl)meth­yl]-1H-1,2,3-triazol-1-yl}acetate Abad, Nadeem Missioui, Mohcine Alsubari, Abdulsalam Mague, Joel T. Essassi, El Mokhtar Ramli, Youssef IUCrdata Data Reports The quinoxaline portion of the title mol­ecule, C(21)H(19)N(5)O(3), is not quite planar as indicated by a dihedral angle of 3.38 (7)° between the constituent rings. The mol­ecule is ‘U-shaped’, which is consolidated by an intra­molecular anti­parallel carbonyl electrostatic inter­action with C··O distances of 2.8905 (16) and 3.0221 (15) Å, in the crystal forms corrugated layers through C—H⋯O and C—H⋯N hydrogen bonds and C—H⋯π(ring) and π-stacking inter­actions. [Image: see text] International Union of Crystallography 2022-07-14 /pmc/articles/PMC9635411/ /pubmed/36341047 http://dx.doi.org/10.1107/S2414314622006939 Text en © Abad et al. 2022 https://creativecommons.org/licenses/by/4.0/This is an open-access article distributed under the terms of the Creative Commons Attribution (CC-BY) Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.
spellingShingle Data Reports
Abad, Nadeem
Missioui, Mohcine
Alsubari, Abdulsalam
Mague, Joel T.
Essassi, El Mokhtar
Ramli, Youssef
Crystal structure of ethyl 2-{4-[(2-oxo-3-phenyl-1,2-di­hydro­quinoxalin-1-yl)meth­yl]-1H-1,2,3-triazol-1-yl}acetate
title Crystal structure of ethyl 2-{4-[(2-oxo-3-phenyl-1,2-di­hydro­quinoxalin-1-yl)meth­yl]-1H-1,2,3-triazol-1-yl}acetate
title_full Crystal structure of ethyl 2-{4-[(2-oxo-3-phenyl-1,2-di­hydro­quinoxalin-1-yl)meth­yl]-1H-1,2,3-triazol-1-yl}acetate
title_fullStr Crystal structure of ethyl 2-{4-[(2-oxo-3-phenyl-1,2-di­hydro­quinoxalin-1-yl)meth­yl]-1H-1,2,3-triazol-1-yl}acetate
title_full_unstemmed Crystal structure of ethyl 2-{4-[(2-oxo-3-phenyl-1,2-di­hydro­quinoxalin-1-yl)meth­yl]-1H-1,2,3-triazol-1-yl}acetate
title_short Crystal structure of ethyl 2-{4-[(2-oxo-3-phenyl-1,2-di­hydro­quinoxalin-1-yl)meth­yl]-1H-1,2,3-triazol-1-yl}acetate
title_sort crystal structure of ethyl 2-{4-[(2-oxo-3-phenyl-1,2-di­hydro­quinoxalin-1-yl)meth­yl]-1h-1,2,3-triazol-1-yl}acetate
topic Data Reports
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9635411/
https://www.ncbi.nlm.nih.gov/pubmed/36341047
http://dx.doi.org/10.1107/S2414314622006939
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